2-[6-(3-methylbut-2-enylamino)purin-9-yl]ethyl ethanoate

Systemtic Name: 2-[6-(3-methylbut-2-enylamino)purin-9-yl]ethyl ethanoate Openeye Name: 2-[6-(3-methylbut-2-enylamino)purin-9-yl]ethyl acetate CAS Name: acetic acid 2-[6-(3-methylbut-2-enylamino)-9-purinyl]ethyl ester IUPAC Name: 2-[6-(3-methylbut-2-enylamino)purin-9-yl]ethyl acetate Traditional Name: acetic acid 2-[6-(3-methylbut-2-enylamino)purin-9-yl]ethyl ester Formula: C14H19N5O2 MolecularWeight: 289.33296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCNC1=NC=NC2=C1N=CN2CCOC(=O)C)C

Isomeric SMILES

CC(=CCNC1=NC=NC2=C1N=CN2CCOC(=O)C)C

InChI

InChI=1S/C14H19N5O2/c1-10(2)4-5-15-13-12-14(17-8-16-13)19(9-18-12)6-7-21-11(3)20/h4,8-9H,5-7H2,1-3H3,(H,15,16,17)